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Information card for entry 7121818
Preview
Coordinates | 7121818.cif |
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Original paper (by DOI) | HTML |
Formula | C44 H58 Cl2 N4 O6 |
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Calculated formula | C44 H58 Cl2 N4 O6 |
Title of publication | Anion-π interactions of highly π-acidic dipyridinium-naphthalene diimide salts. |
Authors of publication | Tam, Teck Lip Dexter; Ng, Chee Koon; Lu, Xuefeng; Lim, Zheng Long; Wu, Jishan |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2018 |
Journal volume | 54 |
Journal issue | 53 |
Pages of publication | 7374 - 7377 |
a | 7.9255 ± 0.0005 Å |
b | 9.259 ± 0.0006 Å |
c | 15.1784 ± 0.0009 Å |
α | 96.993 ± 0.002° |
β | 98.728 ± 0.002° |
γ | 98.758 ± 0.002° |
Cell volume | 1076.06 ± 0.12 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0645 |
Residual factor for significantly intense reflections | 0.063 |
Weighted residual factors for significantly intense reflections | 0.171 |
Weighted residual factors for all reflections included in the refinement | 0.1726 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.093 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
228088 (current) | 2019-11-17 | cif/ Updating files of 7121817, 7121818, 7121819, 7121820 Original log message: Adding full bibliography for 7121817--7121820.cif. |
7121818.cif |
208261 | 2018-06-11 | cif/ Adding structures of 7121817, 7121818, 7121819, 7121820 via cif-deposit CGI script. |
7121818.cif |
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Users of the data should acknowledge the original authors of the
structural data.